SCHEMBL7776405

SCHEMBL7776405

C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1C(=O)N[C@@H]1[C@@H](C)C(=O)N1C(=O)c2ccccc2OC12CCCCC2

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7776403 1.00 ALDH1A1 (0.30) ALDH1A1
SCHEMBL3804896 1.00 ALDH1A1 (0.30) ALDH1A1
SCHEMBL14580526 1.00 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8791174 0.87 ELANE (0.30)
SCHEMBL8622545 0.87 ELANE (0.30)
SCHEMBL8791183 0.87 ELANE (0.30)
SCHEMBL9283481 0.86
SCHEMBL14580525 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL9287406 0.85
SCHEMBL7497724 0.85

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635488-B1 Novel process for preparing azetidinone compound and novel starting compound therefor TANABE SEIYAKU CO (JP) 2001-09-26 EP disclosed